4-[4-[(2-azanylpyrimidin-4-yl)amino]phenyl]sulfanylphenol

Systemtic Name: 4-[4-[(2-azanylpyrimidin-4-yl)amino]phenyl]sulfanylphenol Openeye Name: 4-[4-[(2-aminopyrimidin-4-yl)amino]phenyl]sulfanylphenol CAS Name: 4-[[4-[(2-amino-4-pyrimidinyl)amino]phenyl]thio]phenol IUPAC Name: 4-[4-[(2-aminopyrimidin-4-yl)amino]phenyl]sulfanylphenol Traditional Name: 4-[[4-[(2-aminopyrimidin-4-yl)amino]phenyl]thio]phenol Formula: C16H14N4OS MolecularWeight: 310.37356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC(=NC=C2)N)SC3=CC=C(C=C3)O

Isomeric SMILES

C1=CC(=CC=C1NC2=NC(=NC=C2)N)SC3=CC=C(C=C3)O

InChI

InChI=1S/C16H14N4OS/c17-16-18-10-9-15(20-16)19-11-1-5-13(6-2-11)22-14-7-3-12(21)4-8-14/h1-10,21H,(H3,17,18,19,20)